EU7
Summary
| Name: | (1S)-1-[(3R,5R,7R)-tricyclo[3.3.1.1~3,7~]decan-1-yl]ethan-1-amine |
| Synonyms: | S-RIMANTADINE |
| Formula: | C12 H21 N |
| Formal charge: | 0 |
| Formula weight: | 179.302 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1S)-1-[(3R,5R,7R)-tricyclo[3.3.1.1~3,7~]decan-1-yl]ethan-1-amine |
| OpenEye OEToolkits | 2.0.6 | (1~{S})-1-(1-adamantyl)ethanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CC(N)C12CC3CC(C1)CC(C2)C3 |
| InChI | InChI | 1.03 | InChI=1S/C12H21N/c1-8(13)12-5-9-2-10(6-12)4-11(3-9)7-12/h8-11H,2-7,13H2,1H3/t8-,9-,10+,11-,12-/m0/s1 |
| InChIKey | InChI | 1.03 | UBCHPRBFMUDMNC-SVNGYHJRSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H](N)C12CC3CC(CC(C3)C1)C2 |
| SMILES | CACTVS | 3.385 | C[CH](N)C12CC3CC(CC(C3)C1)C2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C[C@@H](C12CC3CC(C1)CC(C3)C2)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(C12CC3CC(C1)CC(C3)C2)N |
